methyl 3-[(2-pyrrolidin-1-ylpyridin-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(2-pyrrolidin-1-ylpyridin-3-yl)carbonylamino]benzoate Openeye Name: methyl 3-[(2-pyrrolidin-1-ylpyridine-3-carbonyl)amino]benzoate CAS Name: 3-[[oxo-[2-(1-pyrrolidinyl)-3-pyridinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(2-pyrrolidin-1-ylpyridine-3-carbonyl)amino]benzoate Traditional Name: 3-[(2-pyrrolidinonicotinoyl)amino]benzoic acid methyl ester Formula: C18H19N3O3 MolecularWeight: 325.36176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)N3CCCC3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)N3CCCC3

InChI

InChI=1S/C18H19N3O3/c1-24-18(23)13-6-4-7-14(12-13)20-17(22)15-8-5-9-19-16(15)21-10-2-3-11-21/h4-9,12H,2-3,10-11H2,1H3,(H,20,22)